REMARK VINA RESULT: -8.4 1.197 1.701 REMARK 9 active torsions: REMARK status: ('A' for Active; 'I' for Inactive) REMARK 1 A between atoms: O_1 and C_7 REMARK 2 A between atoms: O_1 and C_11 REMARK 3 A between atoms: O_2 and C_13 REMARK 4 A between atoms: O_2 and C_16 REMARK 5 A between atoms: C_5 and C_6 REMARK 6 A between atoms: C_5 and C_7 REMARK 7 A between atoms: C_8 and C_11 REMARK 8 A between atoms: C_9 and C_16 REMARK 9 A between atoms: C_13 and C_14 ROOT ATOM 1 C UNL d 1 5.114 3.029 4.029 0.00 0.00 0.055 A ATOM 2 C UNL d 1 3.918 3.430 3.413 0.00 0.00 0.055 A ATOM 3 C UNL d 1 5.238 1.731 4.544 0.00 0.00 0.018 A ATOM 4 C UNL d 1 2.834 2.540 3.387 0.00 0.00 0.018 A ATOM 5 C UNL d 1 4.157 0.848 4.494 0.00 0.00 0.001 A ATOM 6 C UNL d 1 2.952 1.256 3.929 0.00 0.00 0.001 A ENDROOT BRANCH 2 7 ATOM 7 C UNL d 1 3.716 4.767 2.807 0.00 0.00 0.294 C ATOM 8 O UNL d 1 4.586 5.343 2.171 0.00 0.00 -0.259 OA BRANCH 7 9 ATOM 9 O UNL d 1 2.491 5.247 3.123 0.00 0.00 -0.313 OA BRANCH 9 10 ATOM 10 C UNL d 1 2.468 6.492 3.840 0.00 0.00 0.217 C BRANCH 10 11 ATOM 11 C UNL d 1 1.728 6.266 5.129 0.00 0.00 -0.034 A ATOM 12 C UNL d 1 0.328 6.302 5.151 0.00 0.00 0.009 A ATOM 13 C UNL d 1 -0.355 6.325 6.365 0.00 0.00 0.001 A ATOM 14 C UNL d 1 0.355 6.300 7.563 0.00 0.00 0.000 A ATOM 15 C UNL d 1 1.745 6.200 7.551 0.00 0.00 0.001 A ATOM 16 C UNL d 1 2.431 6.174 6.338 0.00 0.00 0.009 A ENDBRANCH 10 11 ENDBRANCH 9 10 ENDBRANCH 7 9 ENDBRANCH 2 7 BRANCH 1 17 ATOM 17 C UNL d 1 6.251 3.950 4.267 0.00 0.00 0.294 C ATOM 18 O UNL d 1 6.299 4.747 5.184 0.00 0.00 -0.259 OA BRANCH 17 19 ATOM 19 O UNL d 1 7.098 3.839 3.221 0.00 0.00 -0.317 OA BRANCH 19 20 ATOM 20 C UNL d 1 8.490 3.638 3.504 0.00 0.00 0.179 C BRANCH 20 21 ATOM 21 C UNL d 1 8.797 2.160 3.288 0.00 0.00 0.026 C BRANCH 21 22 ATOM 22 C UNL d 1 9.155 1.476 4.610 0.00 0.00 -0.002 C ATOM 23 C UNL d 1 8.854 2.346 5.816 0.00 0.00 0.005 C ENDBRANCH 21 22 ENDBRANCH 20 21 ENDBRANCH 19 20 ENDBRANCH 17 19 ENDBRANCH 1 17 TORSDOF 9